CS-1158344
(3-((Ethoxycarbonyl)amino)phenyl)boronic acid
Manufacturer: ChemScene
CAS Number: 100607-14-5
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₁₂BNO₄
Molecular Weight
209.01
Synonyms
None
SMILES
O=C(OCC)NC1=CC=CC(=C1)B(O)O
Tpsa
78.79
Logp
-0.0652
H Acceptors
4
H Donors
3
Rotatable Bonds
3
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂BNO₄
Molecular Weight: 209.01
Synonyms: None
SMILES: O=C(OCC)NC1=CC=CC(=C1)B(O)O
Tpsa: 78.79
Logp: -0.0652
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂BNO₄
Molecular Weight:
209.01
Synonyms:
None
SMILES:
O=C(OCC)NC1=CC=CC(=C1)B(O)O
Tpsa:
78.79
Logp:
-0.0652
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₀FN₃
Molecular Weight: 251.26
Synonyms: None
SMILES: FC=1C=C(N=C(C1)C=2N=CC=CC2)C3=NC=CC=C3
Tpsa: 38.67
Logp: 3.3447
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₀FN₃
Molecular Weight:
251.26
Synonyms:
None
SMILES:
FC=1C=C(N=C(C1)C=2N=CC=CC2)C3=NC=CC=C3
Tpsa:
38.67
Logp:
3.3447
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₄BNO₃
Molecular Weight: 195.03
Synonyms: None
SMILES: OB(O)C1=CC=C(C=C1)CC(N)CO
Tpsa: 86.71
Logp: -1.7715
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₄BNO₃
Molecular Weight:
195.03
Synonyms:
None
SMILES:
OB(O)C1=CC=C(C=C1)CC(N)CO
Tpsa:
86.71
Logp:
-1.7715
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆ClN₃
Molecular Weight: 179.61
Synonyms: None
SMILES: ClC1=NC2=NC=CC=C2N=C1C
Tpsa: 38.67
Logp: 1.98662
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆ClN₃
Molecular Weight:
179.61
Synonyms:
None
SMILES:
ClC1=NC2=NC=CC=C2N=C1C
Tpsa:
38.67
Logp:
1.98662
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0